2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine

C19H26N2O — CID 82450542

IUPAC2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine
SMILESCOCCNCc1c2c(nc3ccc(C(C)C)cc13)CCC2
InChIInChI=1S/C19H26N2O/c1-13(2)14-7-8-19-16(11-14)17(12-20-9-10-22-3)15-5-4-6-18(15)21-19/h7-8,11,13,20H,4-6,9-10,12H2,1-3H3
InChIKeyKAMPPKMAGGZWCL-UHFFFAOYSA-N
MW298.43 g/mol
LogP3.58
Rot. Bonds6

About 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine

2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine (PubChem CID 82450542) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine
PubChem CID82450542
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC Name2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine
SMILESCOCCNCc1c2c(nc3ccc(C(C)C)cc13)CCC2
InChIInChI=1S/C19H26N2O/c1-13(2)14-7-8-19-16(11-14)17(12-20-9-10-22-3)15-5-4-6-18(15)21-19/h7-8,11,13,20H,4-6,9-10,12H2,1-3H3
InChIKeyKAMPPKMAGGZWCL-UHFFFAOYSA-N
XLogP3.58
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-1-amine
CID 82450539
N-[(7-propan-2-yl-1,2,3,4-tetrahydroacridin-9-yl)methyl]butan-2-amine
CID 82450571
N-[(5-fluoro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]-2-methoxyethanamine
CID 82451066
N-[(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine
CID 82450304
N-[(7-chloro-1,2,3,4-tetrahydroacridin-9-yl)methyl]propan-1-amine
CID 82451364
7-propan-2-yl-1,2,3,4-tetrahydroacridine-9-carbohydrazide
CID 82450585
N-[(6,7-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]-2-methylpropan-1-amine
CID 82450952
N-[(7-fluoro-1,2,3,4-tetrahydroacridin-9-yl)methyl]propan-2-amine
CID 82451463
N-[(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]butan-2-amine
CID 82450310
7-propan-2-yl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
CID 82450560
(7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methanethiol
CID 82451972
2-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)acetic acid
CID 82452003

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine?
The IUPAC name of 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine (CID 82450542) is 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine is COCCNCc1c2c(nc3ccc(C(C)C)cc13)CCC2.
What is the InChIKey of 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine?
The InChIKey is KAMPPKMAGGZWCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-13(2)14-7-8-19-16(11-14)17(12-20-9-10-22-3)15-5-4-6-18(15)21-19/h7-8,11,13,20H,4-6,9-10,12H2,1-3H3.
What are the key properties of 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine?
2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine has a molecular weight of 298.43 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(7-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine is sourced from PubChem (CID 82450542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).